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Information card for entry 7228180
Preview
| Coordinates | 7228180.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C22 H18 Ca2 N6 O10 |
|---|---|
| Calculated formula | C22 H18 Ca2 N6 O10 |
| Title of publication | A series of alkaline earth metal coordination polymers constructed from two newly designed imidazole-based dicarboxylate ligands containing pyridinylmethyl group |
| Authors of publication | Cai, Songliang; He, Zi-Hao; Wu, Wan-Hua; Liu, Fang-Xiu; Huang, Xiao-Ling; Zheng, Shengrun; Fan, Jun; Zhang, Wei-Guang |
| Journal of publication | CrystEngComm |
| Year of publication | 2017 |
| a | 14.991 ± 0.005 Å |
| b | 6.826 ± 0.003 Å |
| c | 25.261 ± 0.009 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2584.9 ± 1.7 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 29 |
| Hermann-Mauguin space group symbol | P c a 21 |
| Hall space group symbol | P 2c -2ac |
| Residual factor for all reflections | 0.1605 |
| Residual factor for significantly intense reflections | 0.1244 |
| Weighted residual factors for significantly intense reflections | 0.2848 |
| Weighted residual factors for all reflections included in the refinement | 0.3064 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.089 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 195949 (current) | 2017-05-04 | cif/ Adding structures of 7228178, 7228179, 7228180, 7228181, 7228182, 7228183, 7228184 via cif-deposit CGI script. |
7228180.cif |
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